4-chloro-2-({[3-(5-chloro-1,3-benzoxazol-2-yl)phenyl]imino}methyl)-3,5-dimethyl-6-nitrophenol
Chemical Structure Depiction of
4-chloro-2-({[3-(5-chloro-1,3-benzoxazol-2-yl)phenyl]imino}methyl)-3,5-dimethyl-6-nitrophenol
4-chloro-2-({[3-(5-chloro-1,3-benzoxazol-2-yl)phenyl]imino}methyl)-3,5-dimethyl-6-nitrophenol
Compound characteristics
| Compound ID: | 1141-0108 |
| Compound Name: | 4-chloro-2-({[3-(5-chloro-1,3-benzoxazol-2-yl)phenyl]imino}methyl)-3,5-dimethyl-6-nitrophenol |
| Molecular Weight: | 456.28 |
| Molecular Formula: | C22 H15 Cl2 N3 O4 |
| Smiles: | Cc1c(/C=N/c2cccc(c2)c2nc3cc(ccc3o2)[Cl])c(c(c(C)c1[Cl])[N+]([O-])=O)O |
| Stereo: | ACHIRAL |
| logP: | 6.6973 |
| logD: | 4.9173 |
| logSw: | -6.1505 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 73.435 |
| InChI Key: | NJGPABHMVJZDRG-UHFFFAOYSA-N |